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1706430-20-7 | 4-Methoxy-3-methyl-5-(trifluoromethyl)phenylacetonitrile
CAS No: 1706430-20-7 Catalog No: AG01FGNQ MDL No:
Product Description
Catalog Number:
AG01FGNQ
Chemical Name:
4-Methoxy-3-methyl-5-(trifluoromethyl)phenylacetonitrile
CAS Number:
1706430-20-7
IUPAC Name:
2-[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]acetonitrile
InChI:
InChI=1S/C11H10F3NO/c1-7-5-8(3-4-15)6-9(10(7)16-2)11(12,13)14/h5-6H,3H2,1-2H3
InChI Key:
HJNHSKCSBRLUAO-UHFFFAOYSA-N
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.071g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.202g/mol
Monoisotopic Mass:
229.071g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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